In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | Yes |
Popular Name: N-isopropyl-3-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]propan-1-amine N-isopropyl-3-[(4S)-4-methyl-6,7…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.90 | 6.35 | -39.16 | 2 | 2 | 1 | 20 | 253.435 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 7.18 | -34.83 | 2 | 2 | 1 | 16 | 253.435 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 8.4 | -106.31 | 3 | 2 | 2 | 21 | 254.443 | 5 | ↓ |